Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 11/20 | 0.71 |
| ▸ | DRD4 | P21917 | 8/20 | 0.71 |
| ▸ | HTR2A | P28223 | 7/20 | 0.71 |
| ▸ | HTR1A | P08908 | 5/20 | 0.71 |
| ▸ | DRD3 | P35462 | 2/20 | 0.71 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.71 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.71 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.71 |
| ▸ | DRD1 | P21728 | 1/20 | 0.71 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.71 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.71 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.71 |
| ▸ | HTR2B | P41595 | 1/20 | 0.71 |
| ▸ | HTR1D | P28221 | 8/20 | 0.67 |
| ▸ | CA12 | O43570 | 1/20 | 0.65 |
| ▸ | CA1 | P00915 | 1/20 | 0.65 |
| ▸ | CA2 | P00918 | 1/20 | 0.65 |
| ▸ | CA4 | P22748 | 1/20 | 0.65 |
| ▸ | CA6 | P23280 | 1/20 | 0.65 |
| ▸ | CA5A | P35218 | 1/20 | 0.65 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL7405500 | 0.99 | DRD2 (0.70) | DRD2DRD4HTR2AHTR1ADRD3 | |
| SCHEMBL7400484 | 0.88 | DRD2 (0.79) | DRD2DRD4HTR2AHTR1ADRD3 | |
| SCHEMBL7402292 | 0.87 | DRD2 (0.68) | DRD2DRD4HTR2AHTR1ADRD3 | |
| SCHEMBL7400380 | 0.86 | DRD2 (0.53) | DRD2DRD4HTR2AHTR1ADRD3 | |
| Hydrochloric Acid SCHEMBL8185768 | 0.86 | DRD2 (0.67) | DRD2DRD4HTR2AHTR1ADRD3 | |
| Hydrochloric Acid SCHEMBL8181274 | 0.86 | DRD2 (0.76) | DRD2DRD4HTR2AHTR1ADRD3 | |
| Hydrochloric Acid SCHEMBL8181280 | 0.86 | DRD2 (0.76) | DRD2DRD4HTR2AHTR1ADRD3 | |
| SCHEMBL5698946 | 0.85 | DRD2 (0.82) | DRD2DRD4HTR2AHTR1ADRD3 | |
| SCHEMBL7400706 | 0.84 | DRD2 (0.67) | DRD2DRD4HTR2AHTR1ADRD3 | |
| Hydrochloric Acid SCHEMBL7402186 | 0.84 | DRD2 (0.80) | DRD2DRD4HTR2AHTR1ADRD3 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0737189-B1 | HETEROCYCLIC COMPOUNDS FOR THE TREATMENT OF CNS AND CARDIOVASCULAR DISORDERS | UPJOHN CO (US) | 1999-07-28 | — | — | EP | claimed |
| EP-0737189-A1 | HETEROCYCLIC COMPOUNDS FOR THE TREATMENT OF CNS AND CARDIOVASCULAR DISORDERS | PHARMACIA & UPJOHN COMPANY (US) | 1996-10-16 | — | — | EP | claimed |
| WO-1995018118-A1 | HETEROCYCLIC COMPOUNDS FOR THE TREATMENT OF CNS AND CARDIOVASCULAR DISORDERS | THE UPJOHN COMPANY (US) | 1995-07-06 | — | — | WO | claimed |